N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C522-0721 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide |
| Molecular Weight: | 467.95 |
| Molecular Formula: | C25 H26 Cl N3 O4 |
| Smiles: | Cc1c(CN2CCC(CC2)C(NCc2ccc3c(c2)OCO3)=O)nc(c2ccc(cc2)[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 3.7716 |
| logD: | 2.8123 |
| logSw: | -4.3216 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.622 |
| InChI Key: | XBMHIYQIZSKUSP-UHFFFAOYSA-N |